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The crystal structures of three X2*nH2O (dien = diethylenetriamine, bipyam = di-2-pyridylamine) complexes have been determined by R-ray crystallographic methods, where X = Cl(1-), n = 2 (1); X = ClO4(1-), n = 1 (2); X = NO3(1-), n = 0 (3).All three crystallise in the monoclinic, space group P21/c with Z = 4; in (1) a = 7.78(2), b = 9.75(3), c = 28.01(5) Angstroem, and beta = 115.0(5) deg; in (2) a = 15.683(5), b = 7.621(5), c = 21.044(9) Angstroem, and beta = 121.42(2) deg; and in (3) a = 12.2011(5), b = 16.052(6), c = 9.851(4) Angstroem, and beta = 90.76(2) deg.All three structures were solved by heavy-atom techniques and successive Fourier syntheses; all three complexes involve a distorted five-co-ordinate CuN5 chromophore, whose stereochemistry ranges from distorted square pyramidal in (1), through an intermediate geometry in (2), to a distorted trigonal-bipyramidal stereochemistry in (3).The three stereochemistries represent individual structures in the pathway of the Berry twist and represent cation distortion isomers of the (2+) cation.The angular changes in the CuN5 stereochemistry are paralelled in the electronic reflectance spectra of the three complexes and in the calculated crystal-field energy level of the copper(II) ion.
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Reference:
Tetrahydropyran – Wikipedia,
Tetrahydropyran – an overview | ScienceDirect Topics